RI00003101 | Bilirubin,4TMS,isomer#13 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 872.4216 | Semi standard non polar | 4736.687 |
RI00003102 | Bilirubin,4TMS,isomer#14 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)[NH]2)N([Si](C)(C)C)C1=O | TMS | 872.4216 | Semi standard non polar | 4735.373 |
RI00003103 | Bilirubin,4TMS,isomer#15 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 872.4216 | Semi standard non polar | 4887.2134 |
RI00003104 | Bilirubin,3TMS,isomer#1 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)[NH]3)N2[Si](C)(C)C)NC1=O | TMS | 800.3821 | Standard polar | 7011.2036 |
RI00003105 | Bilirubin,3TMS,isomer#2 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)[NH]2)NC1=O | TMS | 800.3821 | Standard polar | 7013.0728 |
RI00003106 | Bilirubin,3TMS,isomer#3 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)[NH]2)NC1=O | TMS | 800.3821 | Standard polar | 6657.5454 |
RI00003107 | Bilirubin,3TMS,isomer#4 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)[NH]3)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Standard polar | 6666.1113 |
RI00003108 | Bilirubin,3TMS,isomer#5 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)N2[Si](C)(C)C)NC1=O | TMS | 800.3821 | Standard polar | 7056.421 |
RI00003109 | Bilirubin,3TMS,isomer#6 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)N2[Si](C)(C)C)NC1=O | TMS | 800.3821 | Standard polar | 6705.8076 |
RI00003110 | Bilirubin,3TMS,isomer#7 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)[NH]3)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Standard polar | 6712.029 |
RI00003111 | Bilirubin,3TMS,isomer#8 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)[NH]2)NC1=O | TMS | 800.3821 | Standard polar | 6703.8706 |
RI00003112 | Bilirubin,3TMS,isomer#9 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Standard polar | 6701.523 |
RI00003113 | Bilirubin,3TMS,isomer#10 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Standard polar | 6293.931 |
RI00003114 | Bilirubin,3TMS,isomer#11 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)N2[Si](C)(C)C)NC1=O | TMS | 800.3821 | Standard polar | 7056.339 |
RI00003115 | Bilirubin,3TMS,isomer#12 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)N2[Si](C)(C)C)NC1=O | TMS | 800.3821 | Standard polar | 6697.779 |
RI00003116 | Bilirubin,3TMS,isomer#13 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)[NH]3)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Standard polar | 6704.1177 |
RI00003117 | Bilirubin,3TMS,isomer#14 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)[NH]2)NC1=O | TMS | 800.3821 | Standard polar | 6711.8037 |
RI00003118 | Bilirubin,3TMS,isomer#15 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Standard polar | 6709.392 |
RI00003119 | Bilirubin,3TMS,isomer#16 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Standard polar | 6293.901 |
RI00003120 | Bilirubin,3TMS,isomer#17 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)N2[Si](C)(C)C)NC1=O | TMS | 800.3821 | Standard polar | 6777.5635 |
RI00003121 | Bilirubin,3TMS,isomer#18 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Standard polar | 6360.8267 |
RI00003122 | Bilirubin,3TMS,isomer#19 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)N3[Si](C)(C)C)[NH]2)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Standard polar | 6362.062 |
RI00003123 | Bilirubin,3TMS,isomer#20 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O)=C(CC3=C(CCC(=O)O)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)N2[Si](C)(C)C)N([Si](C)(C)C)C1=O | TMS | 800.3821 | Standard polar | 6773.818 |
RI00003124 | Bilirubin,4TMS,isomer#1 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4\NC(=O)C(C)=C4C=C)N3[Si](C)(C)C)N2[Si](C)(C)C)NC1=O | TMS | 872.4216 | Standard polar | 6778.571 |
RI00003125 | Bilirubin,4TMS,isomer#2 | JsmolC=CC1=C(C)/C(=C/C2=C(C)C(CCC(=O)O[Si](C)(C)C)=C(CC3=C(CCC(=O)O[Si](C)(C)C)C(C)=C(/C=C4/C(C=C)=C(C)C(=O)N4[Si](C)(C)C)[NH]3)N2[Si](C)(C)C)NC1=O | TMS | 872.4216 | Standard polar | 6403.963 |